2-[(3R,5R)-3,5-Dimethyl-1-Piperidinyl]Ethyl 4-Amino-5-Chloro-2-Methoxybenzoate

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Properties Simple | Detailed

Formula C17H25ClN2O3
IUPAC Name 2-[(3r,5r)-3,5-dimethyl-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate
Molecular Mass 340.845 g·mol−1
Heat of Formation -556.9 ± 16.7 kJ·mol−1
Dipole Moment 2.85 ± 1.08 D
Volume 413.54 Å 3
Surface Area 331.17 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.13 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(3r,5r)-3,5-dimethyl-1-piperidyl]ethyl 4-amino-5-chloro-2-methoxy-benzoate
  • 2-[(3r,5r)-3,5-dimethylpiperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxy-benzoate
  • 2-[(3r,5r)-3,5-dimethylpiperidin-1-yl]ethyl 4-amino-5-chloro-2-methoxybenzoate
  • 4-amino-5-chloro-2-methoxy-benzoic acid 2-[(3r,5r)-3,5-dimethyl-1-piperidyl]ethyl ester
  • 4-amino-5-chloro-2-methoxybenzoic acid 2-[(3r,5r)-3,5-dimethyl-1-piperidinyl]ethyl ester
InChIKey BUEFUOFMOXJXAR-VXGBXAGGSA-N
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Elements H C N O Cl